SCHEMBL17954135

SCHEMBL17954135

Cc1ccc2[nH]c(C(=O)N3CCN(Cc4ccc(C)c(Cl)c4)CC3)cc2c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 6/20 0.65
HRH4 Q9H3N8 4/20 0.61
KMT2A Q03164 3/20 0.61
MEN1 O00255 2/20 0.61
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
DRD3 P35462 3/20 0.56
KDM4E B2RXH2 1/20 0.55
MAPT P10636 1/20 0.55
HRH3 Q9Y5N1 2/20 0.55
HRH1 P35367 1/20 0.55
HDAC6 Q9UBN7 1/20 0.53
POLB P06746 1/20 0.53
DRD2 P14416 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16599047 0.94 AKR1C3 (0.65) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL17954133 0.91 AKR1C3 (0.73) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL16598942 0.90 AKR1C3 (0.69) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL17954140 0.88 KMT2A (0.73) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL16598573 0.87 KDM4E (0.71) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL16598630 0.87 AKR1C3 (0.70) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL16599077 0.86 AKR1C3 (0.71) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL16598772 0.85 AKR1C3 (0.65) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL16598809 0.83 MEN1 (0.80) AKR1C3HRH4KMT2AMEN1NPC1
SCHEMBL17954128 0.82 KMT2A (0.60) AKR1C3HRH4KMT2AMEN1NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9776979-B2 EBI2 modulators SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2017-10-03 US disclosed
US-20160214951-A1 EBI2 MODULATORS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2016-07-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160214951-A1 EBI2 MODULATORS BIRC2, HAVCR2, MAVS AKR1C3 3119/4885HRH4 3590/4885KMT2A 1057/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.